Advances in Physical Organic Chemistry, Volume 56 presents the latest reviews of recent work in physical organic chemistry. The book provides a valuable source of information that is ideal not only for physical organic chemists applying their expertise to both novel and traditional problems, but also for non-specialists across diverse areas who identify a physical organic component in their approach to research. Chapters due to be included in this release cover flavin-dependent enzyme catalysed reactions, coacervates and their properties, heavy atom tunnelling, machine learning, acidity and substituent effects.
1. 1 Introduction - p. 2 2. 2 The Hammett equation - p. 4 3. 3 The Yukawa-Tsuno equation - p. 10 4. 4 The extended Yukawa-Tsuno equation - p. 19 5. 5 Substituent constants for the extended Yukawa-Tsuno equation - p. 34 6. 6 Application of the extended Yukawa-Tsuno equation - p. 50 7. 7 Concluding remarks - p. 60 8. Acknowledgments - p. 62 9. References - p. 62 10. Chapter Two: Efficient estimation of bond dissociation energies of organic compounds - p. 88 11. Abstract - p. 70 12. 1 Introduction - p. 70 13. 2 A brief introduction of the anchoring method: A bright point - p. 72 14. 3 Aliphatic compounds and structural effects - p. 73 15. 4 Aromatic compounds and the remote substitution effects - p. 97 16. 5 Organic radicals and group additivity (GA) scheme - p. 117 17. 6 The lowest BDEs of stable molecules at room temperature - p. 127 18. 7 Concluding remarks and outlook - p. 129 19. References - p. 131
Advances in Physical Organic Chemistry, Volume 56 presents the latest reviews of recent work in physical organic chemistry. The book provides a valuable source of information that is ideal not only for physical organic chemists applying their expertise to both novel and traditional problems, but also for non-specialists across diverse areas who identify a physical organic component in their approach to research. Chapters due to be included in this release cover flavin-dependent enzyme catalysed reactions, coacervates and their properties, heavy atom tunnelling, machine learning, acidity and substituent effects.
1. 1 Introduction - p. 2 2. 2 The Hammett equation - p. 4 3. 3 The Yukawa-Tsuno equation - p. 10 4. 4 The extended Yukawa-Tsuno equation - p. 19 5. 5 Substituent constants for the extended Yukawa-Tsuno equation - p. 34 6. 6 Application of the extended Yukawa-Tsuno equation - p. 50 7. 7 Concluding remarks - p. 60 8. Acknowledgments - p. 62 9. References - p. 62 10. Chapter Two: Efficient estimation of bond dissociation energies of organic compounds - p. 88 11. Abstract - p. 70 12. 1 Introduction - p. 70 13. 2 A brief introduction of the anchoring method: A bright point - p. 72 14. 3 Aliphatic compounds and structural effects - p. 73 15. 4 Aromatic compounds and the remote substitution effects - p. 97 16. 5 Organic radicals and group additivity (GA) scheme - p. 117 17. 6 The lowest BDEs of stable molecules at room temperature - p. 127 18. 7 Concluding remarks and outlook - p. 129 19. References - p. 131
